In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2006 | 27 | Yes |
Popular Name: N~3~-(tert-butyl)-N~2~-(2-chlorophenyl)-3,4-dihydro-2,3(1H)-isoquinolinedicarboxamide N~3~-(tert-butyl)-N~2~-(2-chloro…
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CAS Number: 318517-20-3
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.99 | 10.19 | -11.23 | 2 | 5 | 0 | 61 | 385.895 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 129 - 131 | KeyOrganics |